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Information card for entry 2007493
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Coordinates | 2007493.cif |
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Original IUCr paper | HTML |
Formula | C36 H26 Br2 Cu N2 O2 |
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Calculated formula | C36 H26 Br2 Cu N2 O2 |
SMILES | c12ccccc1c1C=[N]([Cu]3([N](=Cc4c(ccc5ccccc45)O3)c3ccc(C)cc3Br)Oc1cc2)c1ccc(C)cc1Br |
Title of publication | Bis[<i>N</i>-(2-bromo-4-methylphenyl)naphthaldiminato]copper(II) |
Authors of publication | Elerman, Yalc̨in; Elmali, Ayhan; Özbey, Süheyla |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1998 |
Journal volume | 54 |
Journal issue | 8 |
Pages of publication | 1072 - 1074 |
a | 9.255 ± 0.001 Å |
b | 12.524 ± 0.002 Å |
c | 13.538 ± 0.002 Å |
α | 90° |
β | 104.32 ± 0.01° |
γ | 90° |
Cell volume | 1520.4 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.098 |
Residual factor for significantly intense reflections | 0.056 |
Weighted residual factors for all reflections | 0.097 |
Weighted residual factors for significantly intense reflections | 0.09 |
Goodness-of-fit parameter for all reflections | 1.208 |
Goodness-of-fit parameter for significantly intense reflections | 1.387 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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